CID 62074318

6-amino-n-benzyl-n-methylpyridine-3-carboxamide

Structural Information

Molecular Formula
C14H15N3O
SMILES
CN(CC1=CC=CC=C1)C(=O)C2=CN=C(C=C2)N
InChI
InChI=1S/C14H15N3O/c1-17(10-11-5-3-2-4-6-11)14(18)12-7-8-13(15)16-9-12/h2-9H,10H2,1H3,(H2,15,16)
InChIKey
LQSZUVDTNDVMED-UHFFFAOYSA-N
Compound name
6-amino-N-benzyl-N-methylpyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.1215 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.12878 155.2
[M+Na]+ 264.11072 161.2
[M-H]- 240.11422 161.4
[M+NH4]+ 259.15532 170.8
[M+K]+ 280.08466 158.5
[M+H-H2O]+ 224.11876 146.2
[M+HCOO]- 286.11970 179.7
[M+CH3COO]- 300.13535 199.8
[M+Na-2H]- 262.09617 160.5
[M]+ 241.12095 154.0
[M]- 241.12205 154.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.